CID 30101
TL;DR: CID 30101 (CAS 20304-49-8) is a chemical compound with molecular formula C29H40O10 and molecular weight 548.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,9,10,22-tetrahydroxy-7,18-dimethyl-19-(5-oxo-2H-furan-3-yl)-4,6,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosane-14-carbaldehyde
Also Known As: CALOTOXIN, Aniline sulphate, 8,9,10,22-tetrahydroxy-7,18-dimethyl-19-(5-oxo-2H-furan-3-yl)-4,6,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosane-14-carbaldehyde, 5-alpha-Card-20(22)-enolide, 3-beta-((6-deoxy-beta-D-hexopyranos-2-ulos-1-yl)oxy)-2-alpha,14-dihydroxy-19-oxo-, 5-alpha-Card-20(22)-enolide, 3-beta-((6-deoxy-beta-D-hexopyranos-2-ulos-1-yl)oxy)2-alpha,14-dihydroxy-19-oxo-
| Molecular Formula | C29H40O10 |
|---|---|
| Molecular Weight | 548.26 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 548.26215 |
| Heavy Atoms | 39 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 20304-49-8 |
|---|---|
| SMILES | CC1C(C(C2(C(O1)OC3CC4CCC5C(C4(CC3O2)C=O)CCC6(C5(CCC6C7=CC(=O)OC7)O)C)O)O)O |
| InChIKey | LYSHVSOMKBORDM-UHFFFAOYSA-N |
Product Overview
CID 30101 (CAS 20304-49-8), with molecular formula C29H40O10 and molecular weight 548.26 g/mol. IUPAC: 8,9,10,22-tetrahydroxy-7,18-dimethyl-19-(5-oxo-2H-furan-3-yl)-4,6,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosane-14-carbaldehyde.
Chemical Property Profile of CID 30101
Property Insights of CID 30101
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CID 30101. The TPSA of 152.0 Ų indicates high polarity, suggesting CID 30101 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CID 30101 has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CID 30101?
The CAS number of CID 30101 is 20304-49-8.
What is the molecular formula of CID 30101?
The molecular formula of CID 30101 is C29H40O10.
What is the molecular weight of CID 30101?
The molecular weight of CID 30101 is 548.26 g/mol.
Where can I buy CID 30101?
You can request a quote for CID 30101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 30101?
Yes, KEHONG BIO provides custom synthesis services for CID 30101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.